5-(2,6-diphenylpyran-4-ylidene)benzo[a]phenothiazin-12-ium

Systemtic Name: 5-(2,6-diphenylpyran-4-ylidene)benzo[a]phenothiazin-12-ium Openeye Name: 5-(2,6-diphenylpyran-4-ylidene)benzo[a]phenothiazin-12-ium CAS Name: 5-(2,6-diphenyl-4-pyranylidene)benzo[a]phenothiazin-12-ium IUPAC Name: 5-(2,6-diphenylpyran-4-ylidene)benzo[a]phenothiazin-12-ium Traditional Name: 5-(2,6-diphenylpyran-4-ylidene)benzo[a]phenothiazin-12-ium Formula: C33H22NOS+ MolecularWeight: 480.59888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C3C=C4C(=[NH+]C5=CC=CC=C5S4)C6=CC=CC=C63)C=C(O2)C7=CC=CC=C7

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C3C=C4C(=[NH+]C5=CC=CC=C5S4)C6=CC=CC=C63)C=C(O2)C7=CC=CC=C7

InChI

InChI=1S/C33H21NOS/c1-3-11-22(12-4-1)29-19-24(20-30(35-29)23-13-5-2-6-14-23)27-21-32-33(26-16-8-7-15-25(26)27)34-28-17-9-10-18-31(28)36-32/h1-21H/p+1